Opened 8 months ago
Closed 8 months ago
#17032 closed defect (duplicate)
Mac multi-display crash
| Reported by: | Owned by: | Tom Goddard | |
|---|---|---|---|
| Priority: | normal | Milestone: | |
| Component: | Platform | Version: | |
| Keywords: | Cc: | ||
| Blocked By: | Blocking: | ||
| Notify when closed: | Platform: | all | |
| Project: | ChimeraX |
Description
The following bug report has been submitted:
Platform: macOS-15.3.1-arm64-arm-64bit
ChimeraX Version: 1.9 (2024-12-11 19:11:19 UTC)
Description
Last time you used ChimeraX it crashed.
This is a known crash that we are unable to fix. Here is information that may help you avoid this crash. The Qt window toolkit crashed due to a display configuration change, typically when waking from sleep or when an external display is disconnected or connected. This has only been seen on Mac computers. We hope a newer version of Qt will fix it. We update ChimeraX daily builds whenever a new Qt is released. You can check here https://www.cgl.ucsf.edu/chimerax/docs/troubleshoot.html#macdisplay to see if it has been fixed in a newer ChimeraX.
Fatal Python error: Segmentation fault
Current thread 0x00000001f10f8840 (most recent call first):
File "/Applications/ChimeraX-1.9.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/ui/gui.py", line 330 in event_loop
File "/Applications/ChimeraX-1.9.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py", line 1054 in init
File "/Applications/ChimeraX-1.9.app/Contents/Library/Frameworks/Python.framework/Versions/3.11/lib/python3.11/site-packages/chimerax/core/__main__.py", line 1217 in
File "", line 88 in _run_code
File "", line 198 in _run_module_as_main
Extension modules: chimerax.arrays._arrays, numpy.core._multiarray_umath, numpy.core._multiarray_tests, numpy.linalg._umath_linalg, numpy.fft._pocketfft_internal, numpy.random._common, numpy.random.bit_generator, numpy.random._bounded_integers, numpy.random._mt19937, numpy.random.mtrand, numpy.random._philox, numpy.random._pcg64, numpy.random._sfc64, numpy.random._generator, chimerax.geometry._geometry, PyQt6.QtCore, PyQt6.QtGui, PyQt6.QtWidgets, PyQt6.QtNetwork, PyQt6.QtPrintSupport, PyQt6.QtWebChannel, PyQt6.QtWebEngineCore, PyQt6.QtWebEngineWidgets, chimerax.atomic_lib._load_libs, tinyarray, chimerax.atomic.cymol, chimerax.atomic.cytmpl, chimerax.pdb_lib._load_libs, chimerax.map._map, charset_normalizer.md, requests.packages.charset_normalizer.md, requests.packages.chardet.md, PIL._imaging, kiwisolver._cext, OpenGL_accelerate.errorchecker, OpenGL_accelerate.wrapper, OpenGL_accelerate.formathandler, OpenGL_accelerate.arraydatatype, OpenGL_accelerate.latebind, OpenGL_accelerate.vbo, chimerax.surface._surface, chimerax.core._mac_util, OpenGL_accelerate.numpy_formathandler, OpenGL_accelerate.nones_formathandler, chimerax.pdb._pdbio, chimerax.atomic._ribbons, chimerax.graphics._graphics, chimerax.mmcif._mmcif, chimerax.mmcif.mmcif, chimerax.alignment_algs._sw, chimerax.dssp._dssp, chimerax.alignment_algs._nw, PIL._imagingmath, PyQt6.QtOpenGL, PyQt6.QtOpenGLWidgets, lz4._version, lz4.frame._frame, msgpack._cmsgpack, chimerax.core._serialize (total: 59)
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{
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"procRole" : "Background",
"version" : 2,
"userID" : 1441484248,
"deployVersion" : 210,
"modelCode" : "Mac16,5",
"coalitionID" : 39675,
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"build" : "24D70",
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"captureTime" : "2025-03-06 20:40:47.1062 +0100",
"codeSigningMonitor" : 2,
"incident" : "73597751-CD8F-4C75-88D2-3AF44CF80C80",
"pid" : 57164,
"translated" : false,
"cpuType" : "ARM-64",
"roots_installed" : 0,
"bug_type" : "309",
"procLaunch" : "2025-03-06 10:47:39.7475 +0100",
"procStartAbsTime" : 20861615134615,
"procExitAbsTime" : 21585667028590,
"procName" : "ChimeraX",
"procPath" : "\/Applications\/ChimeraX-1.9.app\/Contents\/MacOS\/ChimeraX",
"bundleInfo" : {"CFBundleShortVersionString":"1.9.0","CFBundleVersion":"1.9.0.0","CFBundleIdentifier":"edu.ucsf.cgl.ChimeraX"},
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"parentProc" : "bash",
"parentPid" : 56749,
"coalitionName" : "com.apple.Terminal",
"crashReporterKey" : "463002AC-9A46-E5A5-7692-EE5859975FF9",
"responsiblePid" : 2429,
"responsibleProc" : "Terminal",
"codeSigningID" : "edu.ucsf.cgl.ChimeraX",
"codeSigningTeamID" : "LWV8X224YF",
"codeSigningFlags" : 570491649,
"codeSigningValidationCategory" : 6,
"codeSigningTrustLevel" : 4294967295,
"instructionByteStream" : {"beforePC":"fyMD1f17v6n9AwCRcuD\/l78DAJH9e8Go\/w9f1sADX9YQKYDSARAA1A==","atPC":"AwEAVH8jA9X9e7+p\/QMAkWfg\/5e\/AwCR\/XvBqP8PX9bAA1\/WcAqA0g=="},
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"wakeTime" : 2884,
"sleepWakeUUID" : "CC4208B1-DF3E-4CFB-9A62-0C2763B42B3B",
"sip" : "enabled",
"vmRegionInfo" : "0x24c48ed89298 is not in any region. Bytes after previous region: 39945592410777 Bytes before following region: 65126487518568\n REGION TYPE START - END [ VSIZE] PRT\/MAX SHRMOD REGION DETAIL\n commpage (reserved) 1000000000-7000000000 [384.0G] ---\/--- SM=NUL reserved VM address space (unallocated)\n---> GAP OF 0x5f9000000000 BYTES\n MALLOC_NANO 600000000000-600020000000 [512.0M] rw-\/rwx SM=PRV ",
"exception" : {"codes":"0x0000000000000001, 0x0000a4c48ed89298","rawCodes":[1,181164117103256],"type":"EXC_BAD_ACCESS","signal":"SIGSEGV","subtype":"KERN_INVALID_ADDRESS at 0x0000a4c48ed89298 -> 0x000024c48ed89298 (possible pointer authentication failure)"},
"termination" : {"flags":0,"code":11,"namespace":"SIGNAL","indicator":"Segmentation fault: 11","byProc":"ChimeraX","byPid":57164},
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"rollouts" : [
{
"rolloutId" : "5ffde50ce2aacd000d47a95f",
"factorPackIds" : {
},
"deploymentId" : 240000460
},
{
"rolloutId" : "639124e81d92412bfb4880b3",
"factorPackIds" : {
},
"deploymentId" : 240000012
}
],
"experiments" : [
]
}
}
===== Log before crash start =====
Startup Messages
---
note | available bundle cache has not been initialized yet
UCSF ChimeraX version: 1.9 (2024-12-11)
© 2016-2024 Regents of the University of California. All rights reserved.
How to cite UCSF ChimeraX
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Papier_rif2BAT_2025/Figure_1B_1C_globalview.cxc
> graphics silhouettes true
> lighting soft
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/models/scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb
Chain information for
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb
#1
---
Chain | Description
A | No description available
B | No description available
C | No description available
Computing secondary structure
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/models/scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_002_alphafold2_multimer_v3_model_1_seed_90195.pdb
Chain information for
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_002_alphafold2_multimer_v3_model_1_seed_90195.pdb
#2
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/models/scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_003_alphafold2_multimer_v3_model_5_seed_90196.pdb
Chain information for
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_003_alphafold2_multimer_v3_model_5_seed_90196.pdb
#3
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/models/scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_004_alphafold2_multimer_v3_model_1_seed_90196.pdb
Chain information for
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_004_alphafold2_multimer_v3_model_1_seed_90196.pdb
#4
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/models/scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_005_alphafold2_multimer_v3_model_2_seed_90197.pdb
Chain information for
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_005_alphafold2_multimer_v3_model_2_seed_90197.pdb
#5
---
Chain | Description
A | No description available
B | No description available
C | No description available
> mmaker #2/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_002_alphafold2_multimer_v3_model_1_seed_90195.pdb,
chain B (#2), sequence alignment score = 1113.2
RMSD between 212 pruned atom pairs is 0.104 angstroms; (across all 212 pairs:
0.104)
> mmaker #3/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_003_alphafold2_multimer_v3_model_5_seed_90196.pdb,
chain B (#3), sequence alignment score = 1116.2
RMSD between 212 pruned atom pairs is 0.317 angstroms; (across all 212 pairs:
0.317)
> mmaker #4/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_004_alphafold2_multimer_v3_model_1_seed_90196.pdb,
chain B (#4), sequence alignment score = 1116.2
RMSD between 212 pruned atom pairs is 0.159 angstroms; (across all 212 pairs:
0.159)
> mmaker #5/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_005_alphafold2_multimer_v3_model_2_seed_90197.pdb,
chain B (#5), sequence alignment score = 1116.2
RMSD between 212 pruned atom pairs is 0.220 angstroms; (across all 212 pairs:
0.220)
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/models/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_001_alphafold2_multimer_v3_model_2_seed_74781.pdb
Chain information for
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_001_alphafold2_multimer_v3_model_2_seed_74781.pdb
#6
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/models/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_002_alphafold2_multimer_v3_model_2_seed_74777.pdb
Chain information for
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_002_alphafold2_multimer_v3_model_2_seed_74777.pdb
#7
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/models/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_003_alphafold2_multimer_v3_model_2_seed_74779.pdb
Chain information for
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_003_alphafold2_multimer_v3_model_2_seed_74779.pdb
#8
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/models/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_004_alphafold2_multimer_v3_model_2_seed_74780.pdb
Chain information for
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_004_alphafold2_multimer_v3_model_2_seed_74780.pdb
#9
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/models/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_005_alphafold2_multimer_v3_model_2_seed_74778.pdb
Chain information for
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_005_alphafold2_multimer_v3_model_2_seed_74778.pdb
#10
---
Chain | Description
A | No description available
B | No description available
C | No description available
> mmaker #6/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_001_alphafold2_multimer_v3_model_2_seed_74781.pdb,
chain B (#6), sequence alignment score = 685.8
RMSD between 137 pruned atom pairs is 0.745 angstroms; (across all 206 pairs:
3.019)
> mmaker #7/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_002_alphafold2_multimer_v3_model_2_seed_74777.pdb,
chain B (#7), sequence alignment score = 690.6
RMSD between 139 pruned atom pairs is 0.790 angstroms; (across all 206 pairs:
2.958)
> mmaker #8/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_003_alphafold2_multimer_v3_model_2_seed_74779.pdb,
chain B (#8), sequence alignment score = 688.6
RMSD between 141 pruned atom pairs is 0.820 angstroms; (across all 206 pairs:
2.920)
> mmaker #9/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_004_alphafold2_multimer_v3_model_2_seed_74780.pdb,
chain B (#9), sequence alignment score = 685.6
RMSD between 141 pruned atom pairs is 0.771 angstroms; (across all 206 pairs:
2.932)
> mmaker #10/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_005_alphafold2_multimer_v3_model_2_seed_74778.pdb,
chain B (#10), sequence alignment score = 685.8
RMSD between 143 pruned atom pairs is 0.781 angstroms; (across all 206 pairs:
2.817)
> select #1-5/A,B
16470 atoms, 16735 bonds, 2060 residues, 5 models selected
> color sel light grey target acs
> hide sel target a
> show sel target c
> select clear
> select #1-5/C
1185 atoms, 1195 bonds, 150 residues, 5 models selected
> hide sel target a
> show sel target c
> rainbow sel
> select #5-10/A,B
19789 atoms, 20057 bonds, 2472 residues, 6 models selected
> color sel wheat target acs
> hide sel target a
> show sel target c
> select clear
> select #6-10/C
1175 atoms, 1200 bonds, 145 residues, 5 models selected
> rainbow sel
> hide sel target a
> show sel target c
executed Figure_1B_1C_globalview.cxc
> set bgColor white
> hide #5 models
> hide #6 models
> hide #7 models
> hide #8 models
> hide #9 models
> hide #10 models
> ui tool show "Side View"
> save
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Papier_rif2BAT_2025/Figure1A_global1.png.pdb
> hide #4 models
> hide #3 models
> hide #2 models
> hide #1 models
> show #5 models
> show #4 models
> show #3 models
> show #2 models
> show #1 models
> delete all
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Papier_rif2BAT_2025/Figure_1B_1C_globalview.cxc
> set bgColor white
> graphics silhouettes true
> lighting soft
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/models/scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb
Chain information for
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb
#1
---
Chain | Description
A | No description available
B | No description available
C | No description available
Computing secondary structure
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/models/scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_002_alphafold2_multimer_v3_model_1_seed_90195.pdb
Chain information for
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_002_alphafold2_multimer_v3_model_1_seed_90195.pdb
#2
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/models/scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_003_alphafold2_multimer_v3_model_5_seed_90196.pdb
Chain information for
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_003_alphafold2_multimer_v3_model_5_seed_90196.pdb
#3
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/models/scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_004_alphafold2_multimer_v3_model_1_seed_90196.pdb
Chain information for
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_004_alphafold2_multimer_v3_model_1_seed_90196.pdb
#4
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/models/scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_005_alphafold2_multimer_v3_model_2_seed_90197.pdb
Chain information for
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_005_alphafold2_multimer_v3_model_2_seed_90197.pdb
#5
---
Chain | Description
A | No description available
B | No description available
C | No description available
> mmaker #2/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_002_alphafold2_multimer_v3_model_1_seed_90195.pdb,
chain B (#2), sequence alignment score = 1113.2
RMSD between 212 pruned atom pairs is 0.104 angstroms; (across all 212 pairs:
0.104)
> mmaker #3/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_003_alphafold2_multimer_v3_model_5_seed_90196.pdb,
chain B (#3), sequence alignment score = 1116.2
RMSD between 212 pruned atom pairs is 0.317 angstroms; (across all 212 pairs:
0.317)
> mmaker #4/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_004_alphafold2_multimer_v3_model_1_seed_90196.pdb,
chain B (#4), sequence alignment score = 1116.2
RMSD between 212 pruned atom pairs is 0.159 angstroms; (across all 212 pairs:
0.159)
> mmaker #5/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_005_alphafold2_multimer_v3_model_2_seed_90197.pdb,
chain B (#5), sequence alignment score = 1116.2
RMSD between 212 pruned atom pairs is 0.220 angstroms; (across all 212 pairs:
0.220)
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/models/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_001_alphafold2_multimer_v3_model_2_seed_74781.pdb
Chain information for
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_001_alphafold2_multimer_v3_model_2_seed_74781.pdb
#6
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/models/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_002_alphafold2_multimer_v3_model_2_seed_74777.pdb
Chain information for
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_002_alphafold2_multimer_v3_model_2_seed_74777.pdb
#7
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/models/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_003_alphafold2_multimer_v3_model_2_seed_74779.pdb
Chain information for
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_003_alphafold2_multimer_v3_model_2_seed_74779.pdb
#8
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/models/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_004_alphafold2_multimer_v3_model_2_seed_74780.pdb
Chain information for
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_004_alphafold2_multimer_v3_model_2_seed_74780.pdb
#9
---
Chain | Description
A | No description available
B | No description available
C | No description available
> open
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/models/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_005_alphafold2_multimer_v3_model_2_seed_74778.pdb
Chain information for
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_005_alphafold2_multimer_v3_model_2_seed_74778.pdb
#10
---
Chain | Description
A | No description available
B | No description available
C | No description available
> mmaker #6/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_001_alphafold2_multimer_v3_model_2_seed_74781.pdb,
chain B (#6), sequence alignment score = 685.8
RMSD between 137 pruned atom pairs is 0.745 angstroms; (across all 206 pairs:
3.019)
> mmaker #7/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_002_alphafold2_multimer_v3_model_2_seed_74777.pdb,
chain B (#7), sequence alignment score = 690.6
RMSD between 139 pruned atom pairs is 0.790 angstroms; (across all 206 pairs:
2.958)
> mmaker #8/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_003_alphafold2_multimer_v3_model_2_seed_74779.pdb,
chain B (#8), sequence alignment score = 688.6
RMSD between 141 pruned atom pairs is 0.820 angstroms; (across all 206 pairs:
2.920)
> mmaker #9/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_004_alphafold2_multimer_v3_model_2_seed_74780.pdb,
chain B (#9), sequence alignment score = 685.6
RMSD between 141 pruned atom pairs is 0.771 angstroms; (across all 206 pairs:
2.932)
> mmaker #10/A,B to #1/A,B
Computing secondary structure
Parameters
---
Chain pairing | bb
Alignment algorithm | Needleman-Wunsch
Similarity matrix | BLOSUM-62
SS fraction | 0.3
Gap open (HH/SS/other) | 18/18/6
Gap extend | 1
SS matrix | | | H | S | O
---|---|---|---
H | 6 | -9 | -6
S | | 6 | -6
O | | | 4
Iteration cutoff | 2
Matchmaker
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb,
chain B (#1) with
hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_unrelaxed_rank_005_alphafold2_multimer_v3_model_2_seed_74778.pdb,
chain B (#10), sequence alignment score = 685.8
RMSD between 143 pruned atom pairs is 0.781 angstroms; (across all 206 pairs:
2.817)
> select #1-5/A,B
16470 atoms, 16735 bonds, 2060 residues, 5 models selected
> color sel light grey target acs
> hide sel target a
> show sel target c
> select clear
> select #1-5/C
1185 atoms, 1195 bonds, 150 residues, 5 models selected
> hide sel target a
> show sel target c
> rainbow sel
> select #6-10/A,B
16495 atoms, 16710 bonds, 2060 residues, 5 models selected
> color sel wheat target acs
> hide sel target a
> show sel target c
> select clear
> select #6-10/C
1175 atoms, 1200 bonds, 145 residues, 5 models selected
> rainbow sel
> hide sel target a
> show sel target c
executed Figure_1B_1C_globalview.cxc
> hide #6 models
> hide #7 models
> hide #8 models
> hide #9 models
> hide #10 models
> hide #2 models
> show #2 models
> hide #3 models
> show #3 models
> save
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Papier_rif2BAT_2025/Figure_1A_global1.png
> width 1152 height 720 supersample 3
> hide #1 models
> hide #2 models
> hide #3 models
> hide #4 models
> hide #5 models
> show #6 models
> show #7 models
> show #8 models
> show #9 models
> show #10 models
> save
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Papier_rif2BAT_2025/Figure_1A_global2.png
> width 1152 height 720 supersample 3
> select clear
> save
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Papier_rif2BAT_2025/Figure_1A_global2.png
> width 1152 height 720 supersample 3
> hide #7 models
> hide #8 models
> hide #9 models
> hide #10 models
> hide #6 models
> show #1 models
> select #1/C
237 atoms, 239 bonds, 30 residues, 1 model selected
> color sel orange
> style sel ball
Changed 237 atom styles
> show sel atoms
> color sel byhetero
> select #1/C
237 atoms, 239 bonds, 30 residues, 1 model selected
> hide sel atoms
> select #1/C:23
8 atoms, 7 bonds, 1 residue, 1 model selected
> show sel atoms
> select #1/C:@N,CA,C,O
Expected an objects specifier or a keyword
> select #1/C@N,CA,C,O
120 atoms, 119 bonds, 30 residues, 1 model selected
> show sel atoms
> hide sel cartoons
> hide sel atoms
> select #1/C
237 atoms, 239 bonds, 30 residues, 1 model selected
> show sel cartoons
> show #6 models
> show #7 models
> hide #7 models
> show #8 models
> hide #8 models
> show #9 models
> hide #9 models
> show #10 models
> hide #10 models
> hide #6 models
> select #1/C:25-30
44 atoms, 43 bonds, 6 residues, 1 model selected
> hide sel cartoons
> select zone #1/C:23 4.0 #1/A,B
Selected 3 atoms
> select zone #1/C:23 4.0 #1/A,B residues true
Selected 27 atoms
> show sel atoms
> style sel ball
Changed 27 atom styles
> select #1/A,B
3294 atoms, 3347 bonds, 412 residues, 1 model selected
Alignment identifier is 1/A
Alignment identifier is 1/B
> select #1/A:1
8 atoms, 7 bonds, 1 residue, 1 model selected
> select #1/A:1-3
19 atoms, 18 bonds, 3 residues, 1 model selected
> renumber #1/B start 1101
212 residues renumbered
> renumber #1-5/B start 1101
848 residues renumbered
> hide #1 models
> show #6 models
> select #6/A,B
3299 atoms, 3342 bonds, 412 residues, 1 model selected
Alignment identifier is 6/A
Alignment identifier is 6/B
> renumber #6-10/B start 1101
1060 residues renumbered
> select #6/C
235 atoms, 240 bonds, 29 residues, 1 model selected
Alignment identifier is 6/C
> select zone #1/C:23 4.0 #1/A,B residues true
Selected 27 atoms
> hide #6 models
> show #1 models
> label sel text "{0.name} {0.number}{0.insertion_code}"
> graphics silhouettes false
> graphics silhouettes true
> lighting soft
> ui mousemode right "move label"
> ui mousemode right label
> label #1/C:23
> ui mousemode right "move label"
> select #1/C:23
8 atoms, 7 bonds, 1 residue, 1 model selected
> ui tool show "Color Actions"
> color sel orange target l
> show #2 models
> hide #2 models
> show #2 models
> hide #2 models
> show #3 models
> hide #3 models
> show #4 models
> hide #4 models
> show #5 models
> hide #5 models
> ui mousemode right translate
> select zone #1/C:23 4.5 #1/A,B residues true
Selected 27 atoms
> show sel atoms
> select clear
> save
> "/Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Papier_rif2BAT_2025/Figure
> 1B_2I23_around.png" width 1152 height 720 supersample 3
> hide #!1 models
> show #5 models
> hide #5 models
> show #6 models
> renumber #6-10/C start 449
145 residues renumbered
> select #6.C:453,465
Expected an objects specifier or a keyword
> select #6/C:453,465
28 atoms, 30 bonds, 2 residues, 1 model selected
> show sel atoms
> color #1/C lawn green
> color #1/C lawn green target ac
> color #6/C lawn green target ac
> label sel text "{0.name} {0.number}{0.insertion_code}"
> select zone #6/C:453
Missing or invalid "range" argument: Expected a number
> select zone #6/C:
Missing or invalid "near" argument: only initial part "#6/C" of atom specifier
valid
> select zone #6/C:453 4.0 #6/A,B residues true
Selected 57 atoms
> show sel atoms
> style sel ball
Changed 57 atom styles
> label sel text "{0.name} {0.number}{0.insertion_code}"
> show #!1 models
> hide #!1 models
> show #!1 models
> hide #!1 models
> hide #!6 models
> show #!6 models
> show #!1 models
> hide #!1 models
> show #!1 models
> hide #!1 models
> show #!1 models
> hide #!1 models
> show #!1 models
> hide #!1 models
> show #!1 models
> hide #!1 models
> show #!1 models
> hide #!1 models
> show #!1 models
> hide #!1 models
> select #6:C:453
14 atoms, 15 bonds, 1 residue, 1 model selected
> hide sel cartoons
> show sel atoms
> style sel ball
Changed 14 atom styles
> select #6:C1271,1288
11 atoms, 10 bonds, 1 residue, 1 model selected
> hide sel atoms
> select #6/A,B:1271,1288
20 atoms, 18 bonds, 2 residues, 1 model selected
> hide sel atoms
> ~label sel residues
> select #6/C
235 atoms, 240 bonds, 29 residues, 1 model selected
> show sel cartoons
> ui mousemode right "move label"
> select #6/C:453
14 atoms, 15 bonds, 1 residue, 1 model selected
> ui tool show "Color Actions"
> color sel forest green target l
> select clear
> save
> "/Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Papier_rif2BAT_2025/Figure
> 1B_3_W453_around.png" width 1152 height 720 supersample 3
> save
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Papier_rif2BAT_2025/Figure1_BC.cxs
> show #7 models
> show #8 models
> show #9 models
> show #10 models
> ui tool show "AlphaFold Error Plot"
> alphafold pae #6 file
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/scores/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_scores_rank_001_alphafold2_multimer_v3_model_2_seed_74781.json
> color bfactor #6 palette alphafold
3534 atoms, 441 residues, atom bfactor range 30.4 to 98.4
> hide #7 models
> hide #8 models
> hide #9 models
> hide #10 models
> ui tool show "AlphaFold Error Plot"
> alphafold pae #7 file
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/scores/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_scores_rank_002_alphafold2_multimer_v3_model_2_seed_74777.json
> color bfactor #7 palette alphafold
3534 atoms, 441 residues, atom bfactor range 29.4 to 98.4
> show #7 models
> show #8 models
> ui tool show "AlphaFold Error Plot"
> alphafold pae #8 file
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/scores/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_scores_rank_003_alphafold2_multimer_v3_model_2_seed_74779.json
> color bfactor #8 palette alphafold
3534 atoms, 441 residues, atom bfactor range 28.1 to 98.4
> show #9 models
> ui tool show "AlphaFold Error Plot"
> alphafold pae #9 file
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/scores/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_scores_rank_004_alphafold2_multimer_v3_model_2_seed_74780.json
> color bfactor #9 palette alphafold
3534 atoms, 441 residues, atom bfactor range 28.9 to 98.4
> show #10 models
> ui tool show "AlphaFold Error Plot"
> alphafold pae #10 file
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/scores/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_scores_rank_005_alphafold2_multimer_v3_model_2_seed_74778.json
> color bfactor #10 palette alphafold
3534 atoms, 441 residues, atom bfactor range 28.9 to 98.4
> color #6-10/A,B wheat target c
> color #6-10/A,B wheat target ca
> ui mousemode right translate
> save
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/scores/hRad50_Trf2_IDDR_pLDDT_IDDR.png
> width 1152 height 720 supersample 3
> select #6-10:453
70 atoms, 75 bonds, 5 residues, 5 models selected
> show sel atoms
> select #6-10:449-453
215 atoms, 225 bonds, 25 residues, 5 models selected
> select #6-10:449-452
145 atoms, 145 bonds, 20 residues, 5 models selected
> hide sel cartoons
> ui mousemode right "move label"
> save
> "/Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Papier_rif2BAT_2025/Figure
> 1B_W453_around_pLDDT.png" width 1152 height 720 supersample 3
> ui mousemode right translate
> save
> "/Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Papier_rif2BAT_2025/Figure
> 1B_hRad50_Trf2IDDR_pLDDT.png" width 1152 height 720 supersample 3
> hide #!6 models
> hide #7 models
> hide #8 models
> hide #9 models
> hide #10 models
> show #!1 models
> ui tool show "AlphaFold Error Plot"
> alphafold pae #1 file
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/scores/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_scores_rank_001_alphafold2_multimer_v3_model_2_seed_74781.json
Structure
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb
#1 does not match PAE matrix size 441.The structure has 442 polymer residues
and 0 non-polymer atoms
This can happen if chains or atoms were deleted from the AlphaFold model or if
the PAE data was applied to a structure that was not the one predicted by
AlphaFold. Use the full-length AlphaFold model to show predicted aligned
error.
> ui tool show "AlphaFold Error Plot"
> alphafold pae #1 file
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/hrad50_1-200_1101-1312_trf2IDDR_448_478_25st_88f42/predictions/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478/scores/hrad50_monomer_1-200_1101-1312_trf2IDDR_448_478_scores_rank_001_alphafold2_multimer_v3_model_2_seed_74781.json
Structure
scRad50_1_200_1101_1312_scRif2BAT_1_30_unrelaxed_rank_001_alphafold2_multimer_v3_model_1_seed_90197.pdb
#1 does not match PAE matrix size 441.The structure has 442 polymer residues
and 0 non-polymer atoms
This can happen if chains or atoms were deleted from the AlphaFold model or if
the PAE data was applied to a structure that was not the one predicted by
AlphaFold. Use the full-length AlphaFold model to show predicted aligned
error.
> ui tool show "AlphaFold Error Plot"
> alphafold pae #1 file
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/scores/scRad50_1_200_1101_1312_scRif2BAT_1_30_scores_rank_001_alphafold2_multimer_v3_model_1_seed_90197.json
> color bfactor #1 palette alphafold
3531 atoms, 442 residues, atom bfactor range 31.7 to 98.1
> ui tool show "AlphaFold Error Plot"
> alphafold pae #2 file
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/scores/scRad50_1_200_1101_1312_scRif2BAT_1_30_scores_rank_002_alphafold2_multimer_v3_model_1_seed_90195.json
> color bfactor #2 palette alphafold
3531 atoms, 442 residues, atom bfactor range 33.6 to 97.9
> alphafold pae #2 colorDomains true
> color bfactor #2 palette alphafold
3531 atoms, 442 residues, atom bfactor range 33.6 to 97.9
> show #2 models
> ui tool show "AlphaFold Error Plot"
> alphafold pae #3 file
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/scores/scRad50_1_200_1101_1312_scRif2BAT_1_30_scores_rank_003_alphafold2_multimer_v3_model_5_seed_90196.json
> color bfactor #3 palette alphafold
3531 atoms, 442 residues, atom bfactor range 34.3 to 97.9
> show #3 models
> show #4 models
> ui tool show "AlphaFold Error Plot"
> alphafold pae #4 file
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/scores/scRad50_1_200_1101_1312_scRif2BAT_1_30_scores_rank_004_alphafold2_multimer_v3_model_1_seed_90196.json
> color bfactor #4 palette alphafold
3531 atoms, 442 residues, atom bfactor range 32.7 to 97.9
> show #5 models
> ui tool show "AlphaFold Error Plot"
> alphafold pae #5 file
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/ALphaFold2_I2BC/scRad50_1_200_1101_1312_scRif2BAT_1_30_25st_2f3b3/predictions/scRad50_1_200_1101_1312_scRif2BAT_1_30/scores/scRad50_1_200_1101_1312_scRif2BAT_1_30_scores_rank_005_alphafold2_multimer_v3_model_2_seed_90197.json
> color bfactor #5 palette alphafold
3531 atoms, 442 residues, atom bfactor range 32.5 to 98.2
> select #1-5/A/B
16470 atoms, 16735 bonds, 2060 residues, 5 models selected
> color sel light grey target ac
> select clear
> hide #5 models
> show #5 models
> select #1-5/C:26-30
175 atoms, 170 bonds, 25 residues, 5 models selected
> hide sel cartoons
> hide #5 models
> show #5 models
> hide #4 models
> show #4 models
> hide #3 models
> show #3 models
> hide #3 models
> show #3 models
> hide #3 models
> show #3 models
> hide #3 models
> show #3 models
> hide #3 models
> show #3 models
> hide #3 models
> show #3 models
> hide #3 models
> show #3 models
> save
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Figure1B_scRad50_Rif2BAT_pLDDT.png
> width 964 height 720 supersample 3
> select #1-5/C:23
40 atoms, 35 bonds, 5 residues, 5 models selected
> show sel atoms
> hide #4 models
> show #4 models
> hide #3 models
> ui mousemode right "move label"
> select clear
> save
> /Users/pc126390/Integrative_Modelling/Projet_scRad50_rif2BAT/Figure1B_scRad50_Rif2Bat_pLDDT_zoom.png
> width 964 height 720 supersample 3
===== Log before crash end =====
Log:
Startup Messages
---
note | available bundle cache has not been initialized yet
UCSF ChimeraX version: 1.9 (2024-12-11)
© 2016-2024 Regents of the University of California. All rights reserved.
How to cite UCSF ChimeraX
OpenGL version: 4.1 Metal - 89.3
OpenGL renderer: Apple M4 Max
OpenGL vendor: Apple
Python: 3.11.4
Locale: fr_FR.UTF-8
Qt version: PyQt6 6.7.1, Qt 6.7.1
Qt runtime version: 6.7.3
Qt platform: cocoa
Hardware:
Hardware Overview:
Model Name: MacBook Pro
Model Identifier: Mac16,5
Model Number: Z1FV000H9FN/A
Chip: Apple M4 Max
Total Number of Cores: 14 (10 performance and 4 efficiency)
Memory: 36 GB
System Firmware Version: 11881.81.4
OS Loader Version: 11881.81.4
Software:
System Software Overview:
System Version: macOS 15.3.1 (24D70)
Kernel Version: Darwin 24.3.0
Time since boot: 21 jours, 1 heure et 58 minutes
Graphics/Displays:
Apple M4 Max:
Chipset Model: Apple M4 Max
Type: GPU
Bus: Built-In
Total Number of Cores: 32
Vendor: Apple (0x106b)
Metal Support: Metal 3
Displays:
Color LCD:
Display Type: Built-in Liquid Retina XDR Display
Resolution: 3456 x 2234 Retina
Main Display: Yes
Mirror: Off
Online: Yes
Automatically Adjust Brightness: Yes
Connection Type: Internal
Installed Packages:
alabaster: 1.0.0
anyio: 4.7.0
appdirs: 1.4.4
appnope: 0.1.4
asttokens: 3.0.0
auditwheel: 6.1.0
babel: 2.16.0
beautifulsoup4: 4.12.3
blockdiag: 3.0.0
blosc2: 3.0.0
build: 1.2.1
certifi: 2023.11.17
cftime: 1.6.4.post1
charset-normalizer: 3.4.0
ChimeraX-AddCharge: 1.5.18
ChimeraX-AddH: 2.2.6
ChimeraX-AlignmentAlgorithms: 2.0.2
ChimeraX-AlignmentHdrs: 3.5
ChimeraX-AlignmentMatrices: 2.1
ChimeraX-Alignments: 2.16.1
ChimeraX-AlphaFold: 1.0.1
ChimeraX-AltlocExplorer: 1.1.2
ChimeraX-AmberInfo: 1.0
ChimeraX-Arrays: 1.1
ChimeraX-Atomic: 1.58.8
ChimeraX-AtomicLibrary: 14.1.11
ChimeraX-AtomSearch: 2.0.1
ChimeraX-AxesPlanes: 2.4
ChimeraX-BasicActions: 1.1.2
ChimeraX-BILD: 1.0
ChimeraX-BlastProtein: 3.0.0
ChimeraX-BondRot: 2.0.4
ChimeraX-BugReporter: 1.0.1
ChimeraX-BuildStructure: 2.13.1
ChimeraX-Bumps: 1.0
ChimeraX-BundleBuilder: 1.4.0
ChimeraX-ButtonPanel: 1.0.1
ChimeraX-CageBuilder: 1.0.1
ChimeraX-CellPack: 1.0
ChimeraX-Centroids: 1.4
ChimeraX-ChangeChains: 1.1
ChimeraX-CheckWaters: 1.4
ChimeraX-ChemGroup: 2.0.1
ChimeraX-Clashes: 2.3
ChimeraX-ColorActions: 1.0.5
ChimeraX-ColorGlobe: 1.0
ChimeraX-ColorKey: 1.5.6
ChimeraX-CommandLine: 1.2.5
ChimeraX-ConnectStructure: 2.0.1
ChimeraX-Contacts: 1.0.1
ChimeraX-Core: 1.9
ChimeraX-CoreFormats: 1.2
ChimeraX-coulombic: 1.4.4
ChimeraX-Crosslinks: 1.0
ChimeraX-Crystal: 1.0
ChimeraX-CrystalContacts: 1.0.1
ChimeraX-DataFormats: 1.2.3
ChimeraX-Dicom: 1.2.6
ChimeraX-DistMonitor: 1.4.2
ChimeraX-DockPrep: 1.1.3
ChimeraX-Dssp: 2.0
ChimeraX-EMDB-SFF: 1.0
ChimeraX-ESMFold: 1.0
ChimeraX-FileHistory: 1.0.1
ChimeraX-FunctionKey: 1.0.1
ChimeraX-Geometry: 1.3
ChimeraX-gltf: 1.0
ChimeraX-Graphics: 1.4.1
ChimeraX-Hbonds: 2.5
ChimeraX-Help: 1.3
ChimeraX-HKCage: 1.3
ChimeraX-IHM: 1.1
ChimeraX-ImageFormats: 1.2
ChimeraX-IMOD: 1.0
ChimeraX-IO: 1.0.3
ChimeraX-ItemsInspection: 1.0.1
ChimeraX-IUPAC: 1.0
ChimeraX-KVFinder: 1.2.1
ChimeraX-Label: 1.1.14
ChimeraX-ListInfo: 1.2.2
ChimeraX-Log: 1.2
ChimeraX-LookingGlass: 1.1
ChimeraX-Maestro: 1.9.1
ChimeraX-Map: 1.3
ChimeraX-MapData: 2.0
ChimeraX-MapEraser: 1.0.1
ChimeraX-MapFilter: 2.0.1
ChimeraX-MapFit: 2.0
ChimeraX-MapSeries: 2.1.1
ChimeraX-Markers: 1.0.1
ChimeraX-Mask: 1.0.2
ChimeraX-MatchMaker: 2.1.6
ChimeraX-MCopy: 1.0
ChimeraX-MDcrds: 2.7.2
ChimeraX-MedicalToolbar: 1.1
ChimeraX-Meeting: 1.0.1
ChimeraX-MLP: 1.1.1
ChimeraX-mmCIF: 2.14.2
ChimeraX-MMTF: 2.2
ChimeraX-ModelArchive: 1.0
ChimeraX-Modeller: 1.5.18
ChimeraX-ModelPanel: 1.5
ChimeraX-ModelSeries: 1.0.1
ChimeraX-Mol2: 2.0.3
ChimeraX-Mole: 1.0
ChimeraX-Morph: 1.0.2
ChimeraX-MouseModes: 1.2
ChimeraX-Movie: 1.0
ChimeraX-MutationScores: 1.0
ChimeraX-Neuron: 1.0
ChimeraX-Nifti: 1.2
ChimeraX-NMRSTAR: 1.0.2
ChimeraX-NRRD: 1.2
ChimeraX-Nucleotides: 2.0.3
ChimeraX-OpenCommand: 1.14
ChimeraX-OrthoPick: 1.0.1
ChimeraX-PDB: 2.7.6
ChimeraX-PDBBio: 1.0.1
ChimeraX-PDBLibrary: 1.0.4
ChimeraX-PDBMatrices: 1.0
ChimeraX-PickBlobs: 1.0.1
ChimeraX-Positions: 1.0
ChimeraX-PresetMgr: 1.1.2
ChimeraX-PubChem: 2.2
ChimeraX-ReadPbonds: 1.0.1
ChimeraX-Registration: 1.1.2
ChimeraX-RemoteControl: 1.0
ChimeraX-RenderByAttr: 1.6.2
ChimeraX-RenumberResidues: 1.1
ChimeraX-ResidueFit: 1.0.1
ChimeraX-RestServer: 1.3.1
ChimeraX-RNALayout: 1.0
ChimeraX-RotamerLibMgr: 4.0
ChimeraX-RotamerLibsDunbrack: 2.0
ChimeraX-RotamerLibsDynameomics: 2.0
ChimeraX-RotamerLibsRichardson: 2.0
ChimeraX-SaveCommand: 1.5.1
ChimeraX-SchemeMgr: 1.0
ChimeraX-SDF: 2.0.2
ChimeraX-Segger: 1.0
ChimeraX-Segment: 1.0.1
ChimeraX-Segmentations: 3.5.6
ChimeraX-SelInspector: 1.0
ChimeraX-SeqView: 2.14
ChimeraX-Shape: 1.0.1
ChimeraX-Shell: 1.0.1
ChimeraX-Shortcuts: 1.2.0
ChimeraX-ShowSequences: 1.0.3
ChimeraX-SideView: 1.0.1
ChimeraX-SimilarStructures: 1.0.1
ChimeraX-Smiles: 2.1.2
ChimeraX-SmoothLines: 1.0
ChimeraX-SpaceNavigator: 1.0
ChimeraX-StdCommands: 1.18.1
ChimeraX-STL: 1.0.1
ChimeraX-Storm: 1.0
ChimeraX-StructMeasure: 1.2.1
ChimeraX-Struts: 1.0.1
ChimeraX-Surface: 1.0.1
ChimeraX-SwapAA: 2.0.1
ChimeraX-SwapRes: 2.5
ChimeraX-TapeMeasure: 1.0
ChimeraX-TaskManager: 1.0
ChimeraX-Test: 1.0
ChimeraX-Toolbar: 1.2.3
ChimeraX-ToolshedUtils: 1.2.4
ChimeraX-Topography: 1.0
ChimeraX-ToQuest: 1.0
ChimeraX-Tug: 1.0.1
ChimeraX-UI: 1.41
ChimeraX-Umap: 1.0
ChimeraX-uniprot: 2.3.1
ChimeraX-UnitCell: 1.0.1
ChimeraX-ViewDockX: 1.4.4
ChimeraX-VIPERdb: 1.0
ChimeraX-Vive: 1.1
ChimeraX-VolumeMenu: 1.0.1
ChimeraX-vrml: 1.0
ChimeraX-VTK: 1.0
ChimeraX-WavefrontOBJ: 1.0
ChimeraX-WebCam: 1.0.2
ChimeraX-WebServices: 1.1.4
ChimeraX-Zone: 1.0.1
colorama: 0.4.6
comm: 0.2.2
contourpy: 1.3.1
cxservices: 1.2.3
cycler: 0.12.1
Cython: 3.0.10
debugpy: 1.8.9
decorator: 5.1.1
docutils: 0.21.2
executing: 2.1.0
filelock: 3.15.4
fonttools: 4.55.3
funcparserlib: 2.0.0a0
glfw: 2.8.0
grako: 3.16.5
h11: 0.14.0
h5py: 3.12.1
html2text: 2024.2.26
httpcore: 1.0.7
httpx: 0.28.1
idna: 3.10
ihm: 1.3
imagecodecs: 2024.6.1
imagesize: 1.4.1
ipykernel: 6.29.5
ipython: 8.26.0
ipywidgets: 8.1.5
jedi: 0.19.1
Jinja2: 3.1.4
jupyter_client: 8.6.2
jupyter_core: 5.7.2
jupyterlab_widgets: 3.0.13
kiwisolver: 1.4.7
line_profiler: 4.1.3
lxml: 5.2.2
lz4: 4.3.3
MarkupSafe: 3.0.2
matplotlib: 3.9.2
matplotlib-inline: 0.1.7
msgpack: 1.0.8
ndindex: 1.9.2
nest-asyncio: 1.6.0
netCDF4: 1.6.5
networkx: 3.3
nibabel: 5.2.0
nptyping: 2.5.0
numexpr: 2.10.2
numpy: 1.26.4
openvr: 1.26.701
packaging: 23.2
ParmEd: 4.2.2
parso: 0.8.4
pep517: 0.13.1
pexpect: 4.9.0
pillow: 10.4.0
pip: 24.2
pkginfo: 1.11.1
platformdirs: 4.3.6
prompt_toolkit: 3.0.48
psutil: 6.0.0
ptyprocess: 0.7.0
pure_eval: 0.2.3
py-cpuinfo: 9.0.0
pycollada: 0.8
pydicom: 2.4.4
pyelftools: 0.31
Pygments: 2.18.0
pynmrstar: 3.3.4
pynrrd: 1.0.0
PyOpenGL: 3.1.7
PyOpenGL-accelerate: 3.1.7
pyopenxr: 1.0.3401
pyparsing: 3.2.0
pyproject_hooks: 1.2.0
PyQt6-commercial: 6.7.1
PyQt6-Qt6: 6.7.3
PyQt6-WebEngine-commercial: 6.7.0
PyQt6-WebEngine-Qt6: 6.7.3
PyQt6-WebEngineSubwheel-Qt6: 6.7.3
PyQt6_sip: 13.8.0
python-dateutil: 2.9.0.post0
pytz: 2024.2
pyzmq: 26.2.0
qtconsole: 5.5.2
QtPy: 2.4.2
qtshim: 1.0
RandomWords: 0.4.0
requests: 2.32.3
scipy: 1.14.0
setuptools: 72.1.0
sfftk-rw: 0.8.1
six: 1.16.0
sniffio: 1.3.1
snowballstemmer: 2.2.0
sortedcontainers: 2.4.0
soupsieve: 2.6
Sphinx: 8.0.2
sphinx-autodoc-typehints: 2.2.3
sphinxcontrib-applehelp: 2.0.0
sphinxcontrib-blockdiag: 3.0.0
sphinxcontrib-devhelp: 2.0.0
sphinxcontrib-htmlhelp: 2.1.0
sphinxcontrib-jsmath: 1.0.1
sphinxcontrib-qthelp: 2.0.0
sphinxcontrib-serializinghtml: 2.0.0
stack-data: 0.6.3
superqt: 0.6.3
tables: 3.10.1
tcia_utils: 1.5.1
tifffile: 2024.7.24
tinyarray: 1.2.4
tornado: 6.4.2
traitlets: 5.14.3
typing_extensions: 4.12.2
tzdata: 2024.2
urllib3: 2.2.3
wcwidth: 0.2.13
webcolors: 24.6.0
wheel: 0.43.0
wheel-filename: 1.4.1
widgetsnbextension: 4.0.13
Change History (2)
comment:1 by , 8 months ago
| Component: | Unassigned → Platform |
|---|---|
| Owner: | set to |
| Platform: | → all |
| Project: | → ChimeraX |
| Status: | new → assigned |
| Summary: | ChimeraX bug report submission → Mac multi-display crash |
comment:2 by , 8 months ago
| Resolution: | → duplicate |
|---|---|
| Status: | assigned → closed |
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